SCHEMBL5557997

SCHEMBL5557997

Cn1cnnc1Cn1nc(-c2ccc(CO)o2)c2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 11/20 0.67
HIF1A Q16665 8/20 0.67
EPAS1 Q99814 8/20 0.67
ALDH1A1 P00352 2/20 0.67
CYP1A2 P05177 2/20 0.67
CYP3A4 P08684 2/20 0.67
CYP2C9 P11712 2/20 0.67
CYP2C19 P33261 2/20 0.67
HSD17B10 Q99714 2/20 0.67
KDM4E B2RXH2 1/20 0.67
NPC1 O15118 1/20 0.67
GMNN O75496 1/20 0.67
LMNA P02545 1/20 0.67
TP53 P04637 1/20 0.67
CYP2D6 P10635 1/20 0.67
MAPT P10636 1/20 0.67
HPGD P15428 1/20 0.67
ALOX15 P16050 1/20 0.67
NFKB1 P19838 1/20 0.67
MAPK1 P28482 1/20 0.67

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6028752 0.85 PDE5A (0.67) PDE5AHIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL5564745 0.83 PDE5A (0.67) PDE5AHIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL5559735 0.82 PDE5A (0.65) PDE5AHIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL5563495 0.82 PDE5A (0.68) PDE5AHIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL5564864 0.81 PDE5A (0.68) PDE5AHIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL5558187 0.81 PDE5A (0.68) PDE5AHIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL29352550 0.80 PDE5A (1.00) PDE5AHIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL187837 0.80 PDE5A (1.00) PDE5AHIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL5559180 0.80 PDE5A (0.73) PDE5AHIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL5564026 0.80 PDE5A (0.73) PDE5AHIF1AEPAS1ALDH1A1CYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050187276-A1 Compounds, compositions and methods BIZBIOTECH CO., LTD. (KR) 2005-08-25 US claimed
US-7226941-B2 Compound for treating angiogenesis HIF BIO, INC. (US) 2007-06-05 US disclosed
US-20050187276-A1 Compounds, compositions and methods BIZBIOTECH CO., LTD. (KR) 2005-08-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050187276-A1 Compounds, compositions and methods HIF1A, HIF1AN, EGLN3 PDE5A 1987/4885HIF1A 1/4885EPAS1 50/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.